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

Systemtic Name: [1-(2-diethylaminoethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]-(4-nitrophenyl)methanone Openeye Name: [1-(2-diethylaminoethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]-(4-nitrophenyl)methanone CAS Name: [1-(2-diethylaminoethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]-(4-nitrophenyl)methanone IUPAC Name: [1-(2-diethylaminoethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]-(4-nitrophenyl)methanone Traditional Name: [1-(2-diethylaminoethyl)-3,4-dihydro-2H-1,5-benzodiazepin-5-yl]-(4-nitrophenyl)methanone Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1CCCN(C2=CC=CC=C21)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCN1CCCN(C2=CC=CC=C21)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O3/c1-3-23(4-2)16-17-24-14-7-15-25(21-9-6-5-8-20(21)24)22(27)18-10-12-19(13-11-18)26(28)29/h5-6,8-13H,3-4,7,14-17H2,1-2H3