[1-[3-[[4-(hydroxymethyl)-2,5-dimethyl-phenyl]amino]-3-oxidanylidene-propyl]piperidin-4-yl] N-(2-phenylphenyl)carbamate

Systemtic Name: [1-[3-[[4-(hydroxymethyl)-2,5-dimethyl-phenyl]amino]-3-oxidanylidene-propyl]piperidin-4-yl] N-(2-phenylphenyl)carbamate Openeye Name: [1-[3-[4-(hydroxymethyl)-2,5-dimethyl-anilino]-3-oxo-propyl]-4-piperidyl] N-(2-phenylphenyl)carbamate CAS Name: N-(2-phenylphenyl)carbamic acid [1-[3-[4-(hydroxymethyl)-2,5-dimethylanilino]-3-oxopropyl]-4-piperidinyl] ester IUPAC Name: [1-[3-[4-(hydroxymethyl)-2,5-dimethylanilino]-3-oxopropyl]piperidin-4-yl] N-(2-phenylphenyl)carbamate Traditional Name: N-(2-phenylphenyl)carbamic acid [1-[3-(2,5-dimethyl-4-methylol-anilino)-3-keto-propyl]-4-piperidyl] ester Formula: C30H35N3O4 MolecularWeight: 501.6166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CO)C)NC(=O)CCN2CCC(CC2)OC(=O)NC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1CO)C)NC(=O)CCN2CCC(CC2)OC(=O)NC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C30H35N3O4/c1-21-19-28(22(2)18-24(21)20-34)31-29(35)14-17-33-15-12-25(13-16-33)37-30(36)32-27-11-7-6-10-26(27)23-8-4-3-5-9-23/h3-11,18-19,25,34H,12-17,20H2,1-2H3,(H,31,35)(H,32,36)