1-[2-[[(E)-5-azanyl-5-methyl-hex-2-enoyl]-methyl-amino]-3-naphthalen-2-yl-propanoyl]-N-methyl-4-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[[(E)-5-azanyl-5-methyl-hex-2-enoyl]-methyl-amino]-3-naphthalen-2-yl-propanoyl]-N-methyl-4-(phenylmethyl)piperidine-4-carboxamide Openeye Name: 1-[2-[[(E)-5-amino-5-methyl-hex-2-enoyl]-methyl-amino]-3-(2-naphthyl)propanoyl]-4-benzyl-N-methyl-piperidine-4-carboxamide CAS Name: 1-[2-[[(E)-5-amino-5-methyl-1-oxohex-2-enyl]-methylamino]-3-(2-naphthalenyl)-1-oxopropyl]-N-methyl-4-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-[[(E)-5-amino-5-methylhex-2-enoyl]-methylamino]-3-naphthalen-2-ylpropanoyl]-4-benzyl-N-methylpiperidine-4-carboxamide Traditional Name: 1-[2-[[(E)-5-amino-5-methyl-hex-2-enoyl]-methyl-amino]-3-(2-naphthyl)propanoyl]-4-benzyl-N-methyl-isonipecotamide Formula: C35H44N4O3 MolecularWeight: 568.74886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC=CC(=O)N(C)C(CC1=CC2=CC=CC=C2C=C1)C(=O)N3CCC(CC3)(CC4=CC=CC=C4)C(=O)NC)N

Isomeric SMILES

CC(C)(C/C=C/C(=O)N(C)C(CC1=CC2=CC=CC=C2C=C1)C(=O)N3CCC(CC3)(CC4=CC=CC=C4)C(=O)NC)N

InChI

InChI=1S/C35H44N4O3/c1-34(2,36)18-10-15-31(40)38(4)30(24-27-16-17-28-13-8-9-14-29(28)23-27)32(41)39-21-19-35(20-22-39,33(42)37-3)25-26-11-6-5-7-12-26/h5-17,23,30H,18-22,24-25,36H2,1-4H3,(H,37,42)/b15-10+