6-chloranyl-4-methyl-7-[(4-nitrophenyl)methoxy]-3-(phenylmethyl)chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-[(4-nitrophenyl)methoxy]-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-6-chloro-4-methyl-7-[(4-nitrophenyl)methoxy]chromen-2-one CAS Name: 6-chloro-4-methyl-7-[(4-nitrophenyl)methoxy]-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-6-chloro-4-methyl-7-[(4-nitrophenyl)methoxy]chromen-2-one Traditional Name: 3-benzyl-6-chloro-4-methyl-7-(4-nitrobenzyl)oxy-coumarin Formula: C24H18ClNO5 MolecularWeight: 435.85642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C24H18ClNO5/c1-15-19-12-21(25)23(30-14-17-7-9-18(10-8-17)26(28)29)13-22(19)31-24(27)20(15)11-16-5-3-2-4-6-16/h2-10,12-13H,11,14H2,1H3