N-[2-[(2-chlorophenyl)carbonylamino]ethyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[2-[(2-chlorophenyl)carbonylamino]ethyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-[(2-chlorobenzoyl)amino]ethyl]-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2-[[(2-chlorophenyl)-oxomethyl]amino]ethyl]-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2-[(2-chlorobenzoyl)amino]ethyl]-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-[(2-chlorobenzoyl)amino]ethyl]-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C22H25ClN4O4 MolecularWeight: 444.9113

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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=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCCNC(=O)C3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H25ClN4O4/c1-15-5-4-12-26(14-15)19-9-8-16(13-20(19)27(30)31)21(28)24-10-11-25-22(29)17-6-2-3-7-18(17)23/h2-3,6-9,13,15H,4-5,10-12,14H2,1H3,(H,24,28)(H,25,29)