N-(2-aminophenyl)-4-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-but-2-en-2-yl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-but-2-en-2-yl]benzamide Openeye Name: N-(2-aminophenyl)-4-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methyl-prop-1-enyl]benzamide CAS Name: N-(2-aminophenyl)-4-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methylbut-2-en-2-yl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methylbut-2-en-2-yl]benzamide Traditional Name: N-(2-aminophenyl)-4-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methyl-prop-1-enyl]benzamide Formula: C27H29N3O MolecularWeight: 411.53866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CN1CCC2=CC=CC=C2C1)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N)C

Isomeric SMILES

CC(=C(CN1CCC2=CC=CC=C2C1)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N)C

InChI

InChI=1S/C27H29N3O/c1-19(2)24(18-30-16-15-20-7-3-4-8-23(20)17-30)21-11-13-22(14-12-21)27(31)29-26-10-6-5-9-25(26)28/h3-14H,15-18,28H2,1-2H3,(H,29,31)