2-methyl-N-[3-[1-[3-[(2-nitrophenyl)carbamoylamino]-3-phenyl-propyl]piperidin-4-yl]phenyl]propanamide

Systemtic Name: 2-methyl-N-[3-[1-[3-[(2-nitrophenyl)carbamoylamino]-3-phenyl-propyl]piperidin-4-yl]phenyl]propanamide Openeye Name: 2-methyl-N-[3-[1-[3-[(2-nitrophenyl)carbamoylamino]-3-phenyl-propyl]-4-piperidyl]phenyl]propanamide CAS Name: 2-methyl-N-[3-[1-[3-[[(2-nitroanilino)-oxomethyl]amino]-3-phenylpropyl]-4-piperidinyl]phenyl]propanamide IUPAC Name: 2-methyl-N-[3-[1-[3-[(2-nitrophenyl)carbamoylamino]-3-phenylpropyl]piperidin-4-yl]phenyl]propanamide Traditional Name: 2-methyl-N-[3-[1-[3-[(2-nitrophenyl)carbamoylamino]-3-phenyl-propyl]-4-piperidyl]phenyl]propionamide Formula: C31H37N5O4 MolecularWeight: 543.65658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCC(C3=CC=CC=C3)NC(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CCC(C3=CC=CC=C3)NC(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C31H37N5O4/c1-22(2)30(37)32-26-12-8-11-25(21-26)23-15-18-35(19-16-23)20-17-27(24-9-4-3-5-10-24)33-31(38)34-28-13-6-7-14-29(28)36(39)40/h3-14,21-23,27H,15-20H2,1-2H3,(H,32,37)(H2,33,34,38)