3-(methylaminomethyl)-N-[(1S)-2-oxidanylidene-1-phenyl-propyl]-2-phenyl-1H-isoquinoline-4-carboxamide

Systemtic Name: 3-(methylaminomethyl)-N-[(1S)-2-oxidanylidene-1-phenyl-propyl]-2-phenyl-1H-isoquinoline-4-carboxamide Openeye Name: 3-(methylaminomethyl)-N-[(1S)-2-oxo-1-phenyl-propyl]-2-phenyl-1H-isoquinoline-4-carboxamide CAS Name: 3-(methylaminomethyl)-N-[(1S)-2-oxo-1-phenylpropyl]-2-phenyl-1H-isoquinoline-4-carboxamide IUPAC Name: 3-(methylaminomethyl)-N-[(1S)-2-oxo-1-phenylpropyl]-2-phenyl-1H-isoquinoline-4-carboxamide Traditional Name: N-[(1S)-2-keto-1-phenyl-propyl]-3-(methylaminomethyl)-2-phenyl-1H-isoquinoline-4-carboxamide Formula: C27H27N3O2 MolecularWeight: 425.52218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1=CC=CC=C1)NC(=O)C2=C(N(CC3=CC=CC=C32)C4=CC=CC=C4)CNC

Isomeric SMILES

CC(=O)[C@H](C1=CC=CC=C1)NC(=O)C2=C(N(CC3=CC=CC=C32)C4=CC=CC=C4)CNC

InChI

InChI=1S/C27H27N3O2/c1-19(31)26(20-11-5-3-6-12-20)29-27(32)25-23-16-10-9-13-21(23)18-30(24(25)17-28-2)22-14-7-4-8-15-22/h3-16,26,28H,17-18H2,1-2H3,(H,29,32)/t26-/m1/s1