3-(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)-1-phenethyl-1-(phenylmethyl)urea

Systemtic Name: 3-(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)-1-phenethyl-1-(phenylmethyl)urea Openeye Name: 1-benzyl-3-(4-chloro-3-methoxy-1-oxo-isochromen-7-yl)-1-phenethyl-urea CAS Name: 3-(4-chloro-3-methoxy-1-oxo-2-benzopyran-7-yl)-1-phenethyl-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-(4-chloro-3-methoxy-1-oxoisochromen-7-yl)-1-phenethylurea Traditional Name: 1-benzyl-3-(4-chloro-1-keto-3-methoxy-isochromen-7-yl)-1-phenethyl-urea Formula: C26H23ClN2O4 MolecularWeight: 462.92482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C(C=C2)NC(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4)C(=O)O1)Cl

Isomeric SMILES

COC1=C(C2=C(C=C(C=C2)NC(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4)C(=O)O1)Cl

InChI

InChI=1S/C26H23ClN2O4/c1-32-25-23(27)21-13-12-20(16-22(21)24(30)33-25)28-26(31)29(17-19-10-6-3-7-11-19)15-14-18-8-4-2-5-9-18/h2-13,16H,14-15,17H2,1H3,(H,28,31)