(4-nitrophenyl)-[1-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone

Systemtic Name: (4-nitrophenyl)-[1-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone Openeye Name: (4-nitrophenyl)-[1-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone CAS Name: (4-nitrophenyl)-[1-[2-(1-pyrrolidinyl)ethyl]-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone IUPAC Name: (4-nitrophenyl)-[1-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone Traditional Name: (4-nitrophenyl)-[1-(2-pyrrolidinoethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]methanone Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN2CCCN(C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)CCN2CCCN(C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O3/c27-22(18-8-10-19(11-9-18)26(28)29)25-15-5-14-24(17-16-23-12-3-4-13-23)20-6-1-2-7-21(20)25/h1-2,6-11H,3-5,12-17H2