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

Systemtic Name: (2S,3S)-2-[[4-(diphenylmethyl)piperazin-1-yl]carbonylamino]-3-methyl-pentanoate Openeye Name: (2S,3S)-2-[(4-benzhydrylpiperazine-1-carbonyl)amino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]amino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-[(4-benzhydrylpiperazine-1-carbonyl)amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[(4-benzhydrylpiperazine-1-carbonyl)amino]-3-methyl-valerate Formula: C24H30N3O3- MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O3/c1-3-18(2)21(23(28)29)25-24(30)27-16-14-26(15-17-27)22(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,18,21-22H,3,14-17H2,1-2H3,(H,25,30)(H,28,29)/p-1/t18-,21-/m0/s1