propan-2-yl 3-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]-3-phenyl-propanoate CAS Name: 3-[[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-oxomethyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]-3-phenylpropanoate Traditional Name: 3-[(1-mesyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]-3-phenyl-propionic acid isopropyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

InChI

InChI=1S/C23H28N2O5S/c1-16(2)30-22(26)15-20(17-8-5-4-6-9-17)24-23(27)19-11-12-21-18(14-19)10-7-13-25(21)31(3,28)29/h4-6,8-9,11-12,14,16,20H,7,10,13,15H2,1-3H3,(H,24,27)