2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-1-prop-2-enoxycarbonyl-2,3-dihydro-1,5-benzodiazepin-5-yl]ethanoic acid

Systemtic Name: 2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxidanylidene-1-prop-2-enoxycarbonyl-2,3-dihydro-1,5-benzodiazepin-5-yl]ethanoic acid Openeye Name: 2-[1-allyloxycarbonyl-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid CAS Name: 2-[3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-oxo-1-[oxo(prop-2-enoxy)methyl]-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid IUPAC Name: 2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-1-prop-2-enoxycarbonyl-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid Traditional Name: 2-[1-allyloxycarbonyl-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid Formula: C30H27N3O7 MolecularWeight: 541.55128

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(C(=O)N(C2=CC=CC=C21)CC(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

C=CCOC(=O)N1CC(C(=O)N(C2=CC=CC=C21)CC(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C30H27N3O7/c1-2-15-39-30(38)33-16-24(28(36)32(17-27(34)35)25-13-7-8-14-26(25)33)31-29(37)40-18-23-21-11-5-3-9-19(21)20-10-4-6-12-22(20)23/h2-14,23-24H,1,15-18H2,(H,31,37)(H,34,35)