1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-3-propyl-benzimidazol-2-one

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-3-propyl-benzimidazol-2-one Openeye Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-3-propyl-benzimidazol-2-one CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-propyl-2-benzimidazolone IUPAC Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-propylbenzimidazol-2-one Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-3-propyl-benzimidazol-2-one Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H23N3O2/c1-2-12-23-18-9-5-6-10-19(18)24(21(23)26)15-20(25)22-13-11-16-7-3-4-8-17(16)14-22/h3-10H,2,11-15H2,1H3