methyl 3-methyl-2-[[4-(2-phenylethenyl)piperazin-1-yl]carbonylamino]pentanoate

Systemtic Name: methyl 3-methyl-2-[[4-(2-phenylethenyl)piperazin-1-yl]carbonylamino]pentanoate Openeye Name: methyl 3-methyl-2-[(4-styrylpiperazine-1-carbonyl)amino]pentanoate CAS Name: 3-methyl-2-[[oxo-[4-(2-phenylethenyl)-1-piperazinyl]methyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[[4-(2-phenylethenyl)piperazine-1-carbonyl]amino]pentanoate Traditional Name: 3-methyl-2-[(4-styrylpiperazine-1-carbonyl)amino]valeric acid methyl ester Formula: C20H29N3O3 MolecularWeight: 359.46256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)N1CCN(CC1)C=CC2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)N1CCN(CC1)C=CC2=CC=CC=C2

InChI

InChI=1S/C20H29N3O3/c1-4-16(2)18(19(24)26-3)21-20(25)23-14-12-22(13-15-23)11-10-17-8-6-5-7-9-17/h5-11,16,18H,4,12-15H2,1-3H3,(H,21,25)