3-[4-[[5-bromanyl-6-oxidanylidene-3-(phenylmethyl)cyclohexa-2,4-dien-1-ylidene]methylamino]-2-methyl-phenyl]chromen-2-one

Systemtic Name: 3-[4-[[5-bromanyl-6-oxidanylidene-3-(phenylmethyl)cyclohexa-2,4-dien-1-ylidene]methylamino]-2-methyl-phenyl]chromen-2-one Openeye Name: 3-[4-[(3-benzyl-5-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methyl-phenyl]chromen-2-one CAS Name: 3-[4-[[5-bromo-6-oxo-3-(phenylmethyl)-1-cyclohexa-2,4-dienylidene]methylamino]-2-methylphenyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[(3-benzyl-5-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-2-methylphenyl]chromen-2-one Traditional Name: 3-[4-[(3-benzyl-5-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-methyl-phenyl]coumarin Formula: C30H22BrNO3 MolecularWeight: 524.40458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC=C2C=C(C=C(C2=O)Br)CC3=CC=CC=C3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC=C2C=C(C=C(C2=O)Br)CC3=CC=CC=C3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C30H22BrNO3/c1-19-13-24(11-12-25(19)26-17-22-9-5-6-10-28(22)35-30(26)34)32-18-23-15-21(16-27(31)29(23)33)14-20-7-3-2-4-8-20/h2-13,15-18,32H,14H2,1H3