3-(2-naphthalen-1-ylethanoylamino)-3-[3-nitro-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]propanamide

Systemtic Name: 3-(2-naphthalen-1-ylethanoylamino)-3-[3-nitro-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]propanamide Openeye Name: 3-[4-(4-benzyl-1-piperidyl)-3-nitro-phenyl]-3-[[2-(1-naphthyl)acetyl]amino]propanamide CAS Name: 3-[[2-(1-naphthalenyl)-1-oxoethyl]amino]-3-[3-nitro-4-[4-(phenylmethyl)-1-piperidinyl]phenyl]propanamide IUPAC Name: 3-[4-(4-benzylpiperidin-1-yl)-3-nitrophenyl]-3-[(2-naphthalen-1-ylacetyl)amino]propanamide Traditional Name: 3-[4-(4-benzylpiperidino)-3-nitro-phenyl]-3-[[2-(1-naphthyl)acetyl]amino]propionamide Formula: C33H34N4O4 MolecularWeight: 550.64746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)C(CC(=O)N)NC(=O)CC4=CC=CC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)C(CC(=O)N)NC(=O)CC4=CC=CC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C33H34N4O4/c34-32(38)22-29(35-33(39)21-26-11-6-10-25-9-4-5-12-28(25)26)27-13-14-30(31(20-27)37(40)41)36-17-15-24(16-18-36)19-23-7-2-1-3-8-23/h1-14,20,24,29H,15-19,21-22H2,(H2,34,38)(H,35,39)