2-azanyl-4-methyl-1-(4-methylpentyl)-2-pentanoyl-4-(3-phenylphenyl)piperidin-3-one

Systemtic Name: 2-azanyl-4-methyl-1-(4-methylpentyl)-2-pentanoyl-4-(3-phenylphenyl)piperidin-3-one Openeye Name: 2-amino-1-isohexyl-4-methyl-2-pentanoyl-4-(3-phenylphenyl)piperidin-3-one CAS Name: 2-amino-4-methyl-1-(4-methylpentyl)-2-(1-oxopentyl)-4-(3-phenylphenyl)-3-piperidinone IUPAC Name: 2-amino-4-methyl-1-(4-methylpentyl)-2-pentanoyl-4-(3-phenylphenyl)piperidin-3-one Traditional Name: 2-amino-1-isohexyl-4-methyl-4-(3-phenylphenyl)-2-valeryl-3-piperidone Formula: C29H40N2O2 MolecularWeight: 448.6401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1(C(=O)C(CCN1CCCC(C)C)(C)C2=CC=CC(=C2)C3=CC=CC=C3)N

Isomeric SMILES

CCCCC(=O)C1(C(=O)C(CCN1CCCC(C)C)(C)C2=CC=CC(=C2)C3=CC=CC=C3)N

InChI

InChI=1S/C29H40N2O2/c1-5-6-17-26(32)29(30)27(33)28(4,18-20-31(29)19-11-12-22(2)3)25-16-10-15-24(21-25)23-13-8-7-9-14-23/h7-10,13-16,21-22H,5-6,11-12,17-20,30H2,1-4H3