2-(2H-chromen-3-yl)-3-(4-phenylpiperazin-1-yl)-N-(2,3,5-trimethyl-4-oxidanyl-phenyl)propanamide

Systemtic Name: 2-(2H-chromen-3-yl)-3-(4-phenylpiperazin-1-yl)-N-(2,3,5-trimethyl-4-oxidanyl-phenyl)propanamide Openeye Name: 2-(2H-chromen-3-yl)-N-(4-hydroxy-2,3,5-trimethyl-phenyl)-3-(4-phenylpiperazin-1-yl)propanamide CAS Name: 2-(2H-1-benzopyran-3-yl)-N-(4-hydroxy-2,3,5-trimethylphenyl)-3-(4-phenyl-1-piperazinyl)propanamide IUPAC Name: 2-(2H-chromen-3-yl)-N-(4-hydroxy-2,3,5-trimethylphenyl)-3-(4-phenylpiperazin-1-yl)propanamide Traditional Name: 2-(2H-chromen-3-yl)-N-(4-hydroxy-2,3,5-trimethyl-phenyl)-3-(4-phenylpiperazino)propionamide Formula: C31H35N3O3 MolecularWeight: 497.6279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)C)C)NC(=O)C(CN2CCN(CC2)C3=CC=CC=C3)C4=CC5=CC=CC=C5OC4

Isomeric SMILES

CC1=CC(=C(C(=C1O)C)C)NC(=O)C(CN2CCN(CC2)C3=CC=CC=C3)C4=CC5=CC=CC=C5OC4

InChI

InChI=1S/C31H35N3O3/c1-21-17-28(22(2)23(3)30(21)35)32-31(36)27(25-18-24-9-7-8-12-29(24)37-20-25)19-33-13-15-34(16-14-33)26-10-5-4-6-11-26/h4-12,17-18,27,35H,13-16,19-20H2,1-3H3,(H,32,36)