N-(2-hydroxyethyl)-3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-pentyl-benzamide

Systemtic Name: N-(2-hydroxyethyl)-3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-pentyl-benzamide Openeye Name: N-(2-hydroxyethyl)-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]-N-pentyl-benzamide CAS Name: N-(2-hydroxyethyl)-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]-N-pentylbenzamide IUPAC Name: N-(2-hydroxyethyl)-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-pentylbenzamide Traditional Name: N-amyl-N-(2-hydroxyethyl)-4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-3-nitro-benzamide Formula: C27H34N4O6 MolecularWeight: 510.58206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCO)C(=O)C1=CC(=C(C=C1)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(CCO)C(=O)C1=CC(=C(C=C1)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)[N+](=O)[O-]

InChI

InChI=1S/C27H34N4O6/c1-2-3-6-13-29(16-17-32)26(33)20-9-10-24(25(18-20)31(35)36)28-14-11-22(12-15-28)30-23-8-5-4-7-21(23)19-37-27(30)34/h4-5,7-10,18,22,32H,2-3,6,11-17,19H2,1H3