2-[[1-[2,3-dihydro-1H-inden-2-yl-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-propan-2-yl]amino]-6-(1-phenylmethoxycarbonylpiperidin-4-yl)hexanoic acid

Systemtic Name: 2-[[1-[2,3-dihydro-1H-inden-2-yl-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-propan-2-yl]amino]-6-(1-phenylmethoxycarbonylpiperidin-4-yl)hexanoic acid Openeye Name: 6-(1-benzyloxycarbonyl-4-piperidyl)-2-[[2-[(2-tert-butoxy-2-oxo-ethyl)-indan-2-yl-amino]-1-methyl-2-oxo-ethyl]amino]hexanoic acid CAS Name: 2-[[1-[2,3-dihydro-1H-inden-2-yl-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-6-(1-phenylmethoxycarbonyl-4-piperidinyl)hexanoic acid IUPAC Name: 2-[[1-[2,3-dihydro-1H-inden-2-yl-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]-1-oxopropan-2-yl]amino]-6-(1-phenylmethoxycarbonylpiperidin-4-yl)hexanoic acid Traditional Name: 2-[[2-[(2-tert-butoxy-2-keto-ethyl)-indan-2-yl-amino]-2-keto-1-methyl-ethyl]amino]-6-(1-carbobenzoxy-4-piperidyl)hexanoic acid Formula: C37H51N3O7 MolecularWeight: 649.81674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC(=O)OC(C)(C)C)C1CC2=CC=CC=C2C1)NC(CCCCC3CCN(CC3)C(=O)OCC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC(C(=O)N(CC(=O)OC(C)(C)C)C1CC2=CC=CC=C2C1)NC(CCCCC3CCN(CC3)C(=O)OCC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C37H51N3O7/c1-26(34(42)40(24-33(41)47-37(2,3)4)31-22-29-15-9-10-16-30(29)23-31)38-32(35(43)44)17-11-8-12-27-18-20-39(21-19-27)36(45)46-25-28-13-6-5-7-14-28/h5-7,9-10,13-16,26-27,31-32,38H,8,11-12,17-25H2,1-4H3,(H,43,44)