quinolin-8-ylmethyl (2S,3S)-2-[(4-chlorophenyl)carbonylamino]-3-methyl-pentanoate

Systemtic Name: quinolin-8-ylmethyl (2S,3S)-2-[(4-chlorophenyl)carbonylamino]-3-methyl-pentanoate Openeye Name: 8-quinolylmethyl (2S,3S)-2-[(4-chlorobenzoyl)amino]-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[(4-chlorophenyl)-oxomethyl]amino]-3-methylpentanoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl (2S,3S)-2-[(4-chlorobenzoyl)amino]-3-methylpentanoate Traditional Name: (2S,3S)-2-[(4-chlorobenzoyl)amino]-3-methyl-valeric acid 8-quinolylmethyl ester Formula: C23H23ClN2O3 MolecularWeight: 410.89332

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC1=CC=CC2=C1N=CC=C2)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OCC1=CC=CC2=C1N=CC=C2)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H23ClN2O3/c1-3-15(2)20(26-22(27)17-9-11-19(24)12-10-17)23(28)29-14-18-7-4-6-16-8-5-13-25-21(16)18/h4-13,15,20H,3,14H2,1-2H3,(H,26,27)/t15-,20-/m0/s1