[7-chloranyl-5-phenyl-2-(phenylcarbamoyloxyamino)-3H-1,4-benzodiazepin-3-yl] phenyl carbonate

Systemtic Name: [7-chloranyl-5-phenyl-2-(phenylcarbamoyloxyamino)-3H-1,4-benzodiazepin-3-yl] phenyl carbonate Openeye Name: [7-chloro-5-phenyl-2-(phenylcarbamoyloxyamino)-3H-1,4-benzodiazepin-3-yl] phenyl carbonate CAS Name: carbonic acid [2-[[anilino(oxo)methoxy]amino]-7-chloro-5-phenyl-3H-1,4-benzodiazepin-3-yl] phenyl ester IUPAC Name: [7-chloro-5-phenyl-2-(phenylcarbamoyloxyamino)-3H-1,4-benzodiazepin-3-yl] phenyl carbonate Traditional Name: carbonic acid [7-chloro-5-phenyl-2-(phenylcarbamoyloxyamino)-3H-1,4-benzodiazepin-3-yl] phenyl ester Formula: C29H21ClN4O5 MolecularWeight: 540.95384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=NC3=C2C=C(C=C3)Cl)NOC(=O)NC4=CC=CC=C4)OC(=O)OC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=NC3=C2C=C(C=C3)Cl)NOC(=O)NC4=CC=CC=C4)OC(=O)OC5=CC=CC=C5

InChI

InChI=1S/C29H21ClN4O5/c30-20-16-17-24-23(18-20)25(19-10-4-1-5-11-19)33-27(38-29(36)37-22-14-8-3-9-15-22)26(32-24)34-39-28(35)31-21-12-6-2-7-13-21/h1-18,27H,(H,31,35)(H,32,34)