4-azanyl-2-ethoxy-N-[1-[(4-methylcyclohexa-1,4-dien-1-yl)methyl]piperidin-4-yl]-5-nitro-benzamide

Systemtic Name: 4-azanyl-2-ethoxy-N-[1-[(4-methylcyclohexa-1,4-dien-1-yl)methyl]piperidin-4-yl]-5-nitro-benzamide Openeye Name: 4-amino-2-ethoxy-N-[1-[(4-methylcyclohexa-1,4-dien-1-yl)methyl]-4-piperidyl]-5-nitro-benzamide CAS Name: 4-amino-2-ethoxy-N-[1-[(4-methyl-1-cyclohexa-1,4-dienyl)methyl]-4-piperidinyl]-5-nitrobenzamide IUPAC Name: 4-amino-2-ethoxy-N-[1-[(4-methylcyclohexa-1,4-dien-1-yl)methyl]piperidin-4-yl]-5-nitrobenzamide Traditional Name: 4-amino-2-ethoxy-N-[1-[(4-methylcyclohexa-1,4-dien-1-yl)methyl]-4-piperidyl]-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)CC3=CCC(=CC3)C)[N+](=O)[O-])N

Isomeric SMILES

CCOC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CCC(=CC3)C)[N+](=O)[O-])N

InChI

InChI=1S/C22H30N4O4/c1-3-30-21-13-19(23)20(26(28)29)12-18(21)22(27)24-17-8-10-25(11-9-17)14-16-6-4-15(2)5-7-16/h4,7,12-13,17H,3,5-6,8-11,14,23H2,1-2H3,(H,24,27)