1-[(2S)-2-(4-methoxyphenyl)-4-(4-nitrophenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone

Systemtic Name: 1-[(2S)-2-(4-methoxyphenyl)-4-(4-nitrophenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone Openeye Name: 1-[(2S)-2-(4-methoxyphenyl)-4-(4-nitrophenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone CAS Name: 1-[(2S)-2-(4-methoxyphenyl)-4-(4-nitrophenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone IUPAC Name: 1-[(2S)-2-(4-methoxyphenyl)-4-(4-nitrophenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone Traditional Name: 1-[(2S)-2-(4-methoxyphenyl)-4-(4-nitrophenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone Formula: C24H21N3O4 MolecularWeight: 415.44124

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)N1[C@@H](CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H21N3O4/c1-16(28)26-23-6-4-3-5-21(23)25-22(17-7-11-19(12-8-17)27(29)30)15-24(26)18-9-13-20(31-2)14-10-18/h3-14,24H,15H2,1-2H3/t24-/m0/s1