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

Systemtic Name: 4-azanyl-N-[1-(2-cyclohexa-1,3-dien-1-ylethyl)piperidin-4-yl]-2-ethoxy-5-nitro-benzamide Openeye Name: 4-amino-N-[1-(2-cyclohexa-1,3-dien-1-ylethyl)-4-piperidyl]-2-ethoxy-5-nitro-benzamide CAS Name: 4-amino-N-[1-[2-(1-cyclohexa-1,3-dienyl)ethyl]-4-piperidinyl]-2-ethoxy-5-nitrobenzamide IUPAC Name: 4-amino-N-[1-(2-cyclohexa-1,3-dien-1-ylethyl)piperidin-4-yl]-2-ethoxy-5-nitrobenzamide Traditional Name: 4-amino-N-[1-(2-cyclohexa-1,3-dien-1-ylethyl)-4-piperidyl]-2-ethoxy-5-nitro-benzamide Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CCC3=CC=CCC3)[N+](=O)[O-])N

Isomeric SMILES

CCOC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CCC3=CC=CCC3)[N+](=O)[O-])N

InChI

InChI=1S/C22H30N4O4/c1-2-30-21-15-19(23)20(26(28)29)14-18(21)22(27)24-17-9-12-25(13-10-17)11-8-16-6-4-3-5-7-16/h3-4,6,14-15,17H,2,5,7-13,23H2,1H3,(H,24,27)