4-azanyl-N-[1-(cyclohexylmethyl)-3-methyl-piperidin-4-yl]-2-methoxy-5-nitro-benzamide

Systemtic Name: 4-azanyl-N-[1-(cyclohexylmethyl)-3-methyl-piperidin-4-yl]-2-methoxy-5-nitro-benzamide Openeye Name: 4-amino-N-[1-(cyclohexylmethyl)-3-methyl-4-piperidyl]-2-methoxy-5-nitro-benzamide CAS Name: 4-amino-N-[1-(cyclohexylmethyl)-3-methyl-4-piperidinyl]-2-methoxy-5-nitrobenzamide IUPAC Name: 4-amino-N-[1-(cyclohexylmethyl)-3-methylpiperidin-4-yl]-2-methoxy-5-nitrobenzamide Traditional Name: 4-amino-N-[1-(cyclohexylmethyl)-3-methyl-4-piperidyl]-2-methoxy-5-nitro-benzamide Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)[N+](=O)[O-])CC3CCCCC3

Isomeric SMILES

CC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)[N+](=O)[O-])CC3CCCCC3

InChI

InChI=1S/C21H32N4O4/c1-14-12-24(13-15-6-4-3-5-7-15)9-8-18(14)23-21(26)16-10-19(25(27)28)17(22)11-20(16)29-2/h10-11,14-15,18H,3-9,12-13,22H2,1-2H3,(H,23,26)