(2S)-2-[[4-(diphenylmethyl)piperazin-1-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[[4-(diphenylmethyl)piperazin-1-yl]carbonylamino]-3-methyl-butanoate Openeye Name: (2S)-2-[(4-benzhydrylpiperazine-1-carbonyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[(4-benzhydrylpiperazine-1-carbonyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-benzhydrylpiperazine-1-carbonyl)amino]-3-methyl-butyrate Formula: C23H28N3O3- MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3/c1-17(2)20(22(27)28)24-23(29)26-15-13-25(14-16-26)21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,17,20-21H,13-16H2,1-2H3,(H,24,29)(H,27,28)/p-1/t20-/m0/s1