N-[(E)-1-(4-acetamidophenyl)ethylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide

Systemtic Name: N-[(E)-1-(4-acetamidophenyl)ethylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Openeye Name: N-[(E)-1-(4-acetamidophenyl)ethylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide CAS Name: N-[(E)-1-(4-acetamidophenyl)ethylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide IUPAC Name: N-[(E)-1-(4-acetamidophenyl)ethylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Traditional Name: N-[(E)-1-(4-acetamidophenyl)ethylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)CN2CCC3=CC=CC=C3C2)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)CN2CCC3=CC=CC=C3C2)/C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C27H28N4O2/c1-19(22-11-13-26(14-12-22)28-20(2)32)29-30-27(33)24-9-7-21(8-10-24)17-31-16-15-23-5-3-4-6-25(23)18-31/h3-14H,15-18H2,1-2H3,(H,28,32)(H,30,33)/b29-19+