4-(3-methylpiperidin-1-yl)-N-[3-(1-methyl-1,2,3,4-tetrazol-5-yl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-(3-methylpiperidin-1-yl)-N-[3-(1-methyl-1,2,3,4-tetrazol-5-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-(3-methyl-1-piperidyl)-N-[3-(1-methyltetrazol-5-yl)phenyl]-3-nitro-benzamide CAS Name: 4-(3-methyl-1-piperidinyl)-N-[3-(1-methyl-5-tetrazolyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-(3-methylpiperidin-1-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]-3-nitrobenzamide Traditional Name: 4-(3-methylpiperidino)-N-[3-(1-methyltetrazol-5-yl)phenyl]-3-nitro-benzamide Formula: C21H23N7O3 MolecularWeight: 421.45242

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C4=NN=NN4C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C4=NN=NN4C)[N+](=O)[O-]

InChI

InChI=1S/C21H23N7O3/c1-14-5-4-10-27(13-14)18-9-8-16(12-19(18)28(30)31)21(29)22-17-7-3-6-15(11-17)20-23-24-25-26(20)2/h3,6-9,11-12,14H,4-5,10,13H2,1-2H3,(H,22,29)