1-[[2-(3,5-dimethoxyphenyl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-naphthalen-1-yl-urea

Systemtic Name: 1-[[2-(3,5-dimethoxyphenyl)carbonyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-naphthalen-1-yl-urea Openeye Name: 1-[[2-(3,5-dimethoxybenzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-(1-naphthyl)urea CAS Name: 1-[[2-[(3,5-dimethoxyphenyl)-oxomethyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-(1-naphthalenyl)urea IUPAC Name: 1-[[2-(3,5-dimethoxybenzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-naphthalen-1-ylurea Traditional Name: 1-[[2-(3,5-dimethoxybenzoyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-3-(1-naphthyl)urea Formula: C30H29N3O4 MolecularWeight: 495.56896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CCC3=CC=CC=C3C2CNC(=O)NC4=CC=CC5=CC=CC=C54)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCC3=CC=CC=C3C2CNC(=O)NC4=CC=CC5=CC=CC=C54)OC

InChI

InChI=1S/C30H29N3O4/c1-36-23-16-22(17-24(18-23)37-2)29(34)33-15-14-21-9-4-6-12-26(21)28(33)19-31-30(35)32-27-13-7-10-20-8-3-5-11-25(20)27/h3-13,16-18,28H,14-15,19H2,1-2H3,(H2,31,32,35)