1-butyl-1-[(10-chloranylanthracen-9-yl)methyl]-3-(3-methylphenyl)urea

Systemtic Name: 1-butyl-1-[(10-chloranylanthracen-9-yl)methyl]-3-(3-methylphenyl)urea Openeye Name: 1-butyl-1-[(10-chloro-9-anthryl)methyl]-3-(m-tolyl)urea CAS Name: 1-butyl-1-[(10-chloro-9-anthracenyl)methyl]-3-(3-methylphenyl)urea IUPAC Name: 1-butyl-1-[(10-chloroanthracen-9-yl)methyl]-3-(3-methylphenyl)urea Traditional Name: 1-butyl-1-[(10-chloro-9-anthryl)methyl]-3-(m-tolyl)urea Formula: C27H27ClN2O MolecularWeight: 430.96908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=C2C=CC=CC2=C(C3=CC=CC=C31)Cl)C(=O)NC4=CC=CC(=C4)C

Isomeric SMILES

CCCCN(CC1=C2C=CC=CC2=C(C3=CC=CC=C31)Cl)C(=O)NC4=CC=CC(=C4)C

InChI

InChI=1S/C27H27ClN2O/c1-3-4-16-30(27(31)29-20-11-9-10-19(2)17-20)18-25-21-12-5-7-14-23(21)26(28)24-15-8-6-13-22(24)25/h5-15,17H,3-4,16,18H2,1-2H3,(H,29,31)