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

Systemtic Name: methyl (2S,3R)-2-[[4-(diphenylmethyl)piperazin-1-yl]carbonylamino]-3-methyl-pentanoate Openeye Name: methyl (2S,3R)-2-[(4-benzhydrylpiperazine-1-carbonyl)amino]-3-methyl-pentanoate CAS Name: (2S,3R)-2-[[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2S,3R)-2-[(4-benzhydrylpiperazine-1-carbonyl)amino]-3-methylpentanoate Traditional Name: (2S,3R)-2-[(4-benzhydrylpiperazine-1-carbonyl)amino]-3-methyl-valeric acid methyl ester Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O3/c1-4-19(2)22(24(29)31-3)26-25(30)28-17-15-27(16-18-28)23(20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-14,19,22-23H,4,15-18H2,1-3H3,(H,26,30)/t19-,22+/m1/s1