methyl (3R,4S)-3,4-dimethyl-2-[[(1S)-1-phenylethyl]carbamoyl]-1,4-dihydroisoquinoline-3-carboxylate

Systemtic Name: methyl (3R,4S)-3,4-dimethyl-2-[[(1S)-1-phenylethyl]carbamoyl]-1,4-dihydroisoquinoline-3-carboxylate Openeye Name: methyl (3R,4S)-3,4-dimethyl-2-[[(1S)-1-phenylethyl]carbamoyl]-1,4-dihydroisoquinoline-3-carboxylate CAS Name: (3R,4S)-3,4-dimethyl-2-[oxo-[[(1S)-1-phenylethyl]amino]methyl]-1,4-dihydroisoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3R,4S)-3,4-dimethyl-2-[[(1S)-1-phenylethyl]carbamoyl]-1,4-dihydroisoquinoline-3-carboxylate Traditional Name: (3R,4S)-3,4-dimethyl-2-[[(1S)-1-phenylethyl]carbamoyl]-1,4-dihydroisoquinoline-3-carboxylic acid methyl ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2CN(C1(C)C(=O)OC)C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1C2=CC=CC=C2CN([C@@]1(C)C(=O)OC)C(=O)N[C@@H](C)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3/c1-15-19-13-9-8-12-18(19)14-24(22(15,3)20(25)27-4)21(26)23-16(2)17-10-6-5-7-11-17/h5-13,15-16H,14H2,1-4H3,(H,23,26)/t15-,16-,22+/m0/s1