N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-3-nitro-4-piperidino-benzamide Formula: C23H30N4O4 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=C(C=C1)N2CCCCC2)[N+](=O)[O-])C3=CC(=CC=C3)OC

Isomeric SMILES

CN(C)[C@H](CNC(=O)C1=CC(=C(C=C1)N2CCCCC2)[N+](=O)[O-])C3=CC(=CC=C3)OC

InChI

InChI=1S/C23H30N4O4/c1-25(2)22(17-8-7-9-19(14-17)31-3)16-24-23(28)18-10-11-20(21(15-18)27(29)30)26-12-5-4-6-13-26/h7-11,14-15,22H,4-6,12-13,16H2,1-3H3,(H,24,28)/t22-/m1/s1