1-heptyl-1-[[4-(3-methylbutyl)phenyl]methyl]-3-(2,4,6-trimethoxyphenyl)urea

Systemtic Name: 1-heptyl-1-[[4-(3-methylbutyl)phenyl]methyl]-3-(2,4,6-trimethoxyphenyl)urea Openeye Name: 1-heptyl-1-[(4-isopentylphenyl)methyl]-3-(2,4,6-trimethoxyphenyl)urea CAS Name: 1-heptyl-1-[[4-(3-methylbutyl)phenyl]methyl]-3-(2,4,6-trimethoxyphenyl)urea IUPAC Name: 1-heptyl-1-[[4-(3-methylbutyl)phenyl]methyl]-3-(2,4,6-trimethoxyphenyl)urea Traditional Name: 1-heptyl-1-(4-isoamylbenzyl)-3-(2,4,6-trimethoxyphenyl)urea Formula: C29H44N2O4 MolecularWeight: 484.67066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=C(C=C1)CCC(C)C)C(=O)NC2=C(C=C(C=C2OC)OC)OC

Isomeric SMILES

CCCCCCCN(CC1=CC=C(C=C1)CCC(C)C)C(=O)NC2=C(C=C(C=C2OC)OC)OC

InChI

InChI=1S/C29H44N2O4/c1-7-8-9-10-11-18-31(21-24-16-14-23(15-17-24)13-12-22(2)3)29(32)30-28-26(34-5)19-25(33-4)20-27(28)35-6/h14-17,19-20,22H,7-13,18,21H2,1-6H3,(H,30,32)