7-[[1-(2-phenylethanimidoyl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide

Systemtic Name: 7-[[1-(2-phenylethanimidoyl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Openeye Name: 7-[[1-(2-phenylethanimidoyl)-4-piperidyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxamidine CAS Name: 7-[[1-(1-imino-2-phenylethyl)-4-piperidinyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide IUPAC Name: 7-[[1-(2-phenylethanimidoyl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide Traditional Name: 7-[[1-(2-phenylacetimidoyl)-4-piperidyl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxamidine Formula: C24H31N5O MolecularWeight: 405.53584

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1COC2=CC3=C(CCN(C3)C(=N)N)C=C2)C(=N)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1COC2=CC3=C(CCN(C3)C(=N)N)C=C2)C(=N)CC4=CC=CC=C4

InChI

InChI=1S/C24H31N5O/c25-23(14-18-4-2-1-3-5-18)28-11-8-19(9-12-28)17-30-22-7-6-20-10-13-29(24(26)27)16-21(20)15-22/h1-7,15,19,25H,8-14,16-17H2,(H3,26,27)