7-chloranyl-N-[(Z)-1,1-dimethoxypropan-2-ylideneamino]-5-phenyl-3H-1,4-benzodiazepin-2-amine

Systemtic Name: 7-chloranyl-N-[(Z)-1,1-dimethoxypropan-2-ylideneamino]-5-phenyl-3H-1,4-benzodiazepin-2-amine Openeye Name: 7-chloro-N-[(Z)-(2,2-dimethoxy-1-methyl-ethylidene)amino]-5-phenyl-3H-1,4-benzodiazepin-2-amine CAS Name: 7-chloro-N-[(Z)-1,1-dimethoxypropan-2-ylideneamino]-5-phenyl-3H-1,4-benzodiazepin-2-amine IUPAC Name: 7-chloro-N-[(Z)-1,1-dimethoxypropan-2-ylideneamino]-5-phenyl-3H-1,4-benzodiazepin-2-amine Traditional Name: (7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-yl)-[(Z)-(2,2-dimethoxy-1-methyl-ethylidene)amino]amine Formula: C20H21ClN4O2 MolecularWeight: 384.85934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3)C(OC)OC

Isomeric SMILES

C/C(=N/NC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3)/C(OC)OC

InChI

InChI=1S/C20H21ClN4O2/c1-13(20(26-2)27-3)24-25-18-12-22-19(14-7-5-4-6-8-14)16-11-15(21)9-10-17(16)23-18/h4-11,20H,12H2,1-3H3,(H,23,25)/b24-13-