2-[[5-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butoxy]naphthalen-2-yl]carbonylamino]-3-oxidanyl-3-phenyl-propanoic acid

Systemtic Name: 2-[[5-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butoxy]naphthalen-2-yl]carbonylamino]-3-oxidanyl-3-phenyl-propanoic acid Openeye Name: 2-[[5-[4-(tert-butoxycarbonylamino)butoxy]naphthalene-2-carbonyl]amino]-3-hydroxy-3-phenyl-propanoic acid CAS Name: 3-hydroxy-2-[[[5-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butoxy]-2-naphthalenyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-hydroxy-2-[[5-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butoxy]naphthalene-2-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[5-[4-(tert-butoxycarbonylamino)butoxy]-2-naphthoyl]amino]-3-hydroxy-3-phenyl-propionic acid Formula: C29H34N2O7 MolecularWeight: 522.58946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCOC1=CC=CC2=C1C=CC(=C2)C(=O)NC(C(C3=CC=CC=C3)O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCOC1=CC=CC2=C1C=CC(=C2)C(=O)NC(C(C3=CC=CC=C3)O)C(=O)O

InChI

InChI=1S/C29H34N2O7/c1-29(2,3)38-28(36)30-16-7-8-17-37-23-13-9-12-20-18-21(14-15-22(20)23)26(33)31-24(27(34)35)25(32)19-10-5-4-6-11-19/h4-6,9-15,18,24-25,32H,7-8,16-17H2,1-3H3,(H,30,36)(H,31,33)(H,34,35)