N-(2-dimethylaminoethyl)-2-(3,4-dimethylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-2-(3,4-dimethylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-2-(3,4-dimethylphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(2-dimethylaminoethyl)-2-(3,4-dimethylphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-2-(3,4-dimethylphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-2-(3,4-dimethylphenyl)-1-keto-isoquinoline-4-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCCN(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCCN(C)C)C

InChI

InChI=1S/C22H25N3O2/c1-15-9-10-17(13-16(15)2)25-14-20(21(26)23-11-12-24(3)4)18-7-5-6-8-19(18)22(25)27/h5-10,13-14H,11-12H2,1-4H3,(H,23,26)