methyl (3S)-2-[(3-methoxy-3-oxidanylidene-propyl)-methyl-carbamoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (3S)-2-[(3-methoxy-3-oxidanylidene-propyl)-methyl-carbamoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3S)-2-[(3-methoxy-3-oxo-propyl)-methyl-carbamoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3S)-2-[[(3-methoxy-3-oxopropyl)-methylamino]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3S)-2-[(3-methoxy-3-oxopropyl)-methylcarbamoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3S)-2-[(3-keto-3-methoxy-propyl)-methyl-carbamoyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C17H22N2O5 MolecularWeight: 334.36698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)OC)C(=O)N1CC2=CC=CC=C2CC1C(=O)OC

Isomeric SMILES

CN(CCC(=O)OC)C(=O)N1CC2=CC=CC=C2C[C@H]1C(=O)OC

InChI

InChI=1S/C17H22N2O5/c1-18(9-8-15(20)23-2)17(22)19-11-13-7-5-4-6-12(13)10-14(19)16(21)24-3/h4-7,14H,8-11H2,1-3H3/t14-/m0/s1