N-(2-benzamidoethyl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-(2-benzamidoethyl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(2-benzamidoethyl)-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(2-benzamidoethyl)-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(2-benzamidoethyl)-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(2-benzamidoethyl)-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCCNC(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCCNC(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O4/c1-16-6-5-13-25(15-16)19-10-9-18(14-20(19)26(29)30)22(28)24-12-11-23-21(27)17-7-3-2-4-8-17/h2-4,7-10,14,16H,5-6,11-13,15H2,1H3,(H,23,27)(H,24,28)