4-azanyl-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)piperidin-4-yl]-2-methoxy-5-nitro-benzamide

Systemtic Name: 4-azanyl-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)piperidin-4-yl]-2-methoxy-5-nitro-benzamide Openeye Name: 4-amino-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)-4-piperidyl]-2-methoxy-5-nitro-benzamide CAS Name: 4-amino-N-[1-(1-cyclohexa-1,3-dienylmethyl)-4-piperidinyl]-2-methoxy-5-nitrobenzamide IUPAC Name: 4-amino-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)piperidin-4-yl]-2-methoxy-5-nitrobenzamide Traditional Name: 4-amino-N-[1-(cyclohexa-1,3-dien-1-ylmethyl)-4-piperidyl]-2-methoxy-5-nitro-benzamide Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CCC3)[N+](=O)[O-])N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CCC3)[N+](=O)[O-])N

InChI

InChI=1S/C20H26N4O4/c1-28-19-12-17(21)18(24(26)27)11-16(19)20(25)22-15-7-9-23(10-8-15)13-14-5-3-2-4-6-14/h2-3,5,11-12,15H,4,6-10,13,21H2,1H3,(H,22,25)