methyl 2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]ethanoate

Systemtic Name: methyl 2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]ethanoate Openeye Name: methyl 2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetate CAS Name: 2-[3-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetate Traditional Name: 2-[3-(9H-fluoren-9-ylmethoxycarbonylamino)-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetic acid methyl ester Formula: C33H27N3O5 MolecularWeight: 545.58458

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C6=CC=CC=C6

Isomeric SMILES

COC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C6=CC=CC=C6

InChI

InChI=1S/C33H27N3O5/c1-40-29(37)19-36-28-18-10-9-17-26(28)30(21-11-3-2-4-12-21)34-31(32(36)38)35-33(39)41-20-27-24-15-7-5-13-22(24)23-14-6-8-16-25(23)27/h2-18,27,31H,19-20H2,1H3,(H,35,39)