4,7-dimethyl-5-[2-oxidanylidene-2-(4-pyrrolidin-1-ylphenyl)ethoxy]-3-(phenylmethyl)chromen-2-one

Systemtic Name: 4,7-dimethyl-5-[2-oxidanylidene-2-(4-pyrrolidin-1-ylphenyl)ethoxy]-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-4,7-dimethyl-5-[2-oxo-2-(4-pyrrolidin-1-ylphenyl)ethoxy]chromen-2-one CAS Name: 4,7-dimethyl-5-[2-oxo-2-[4-(1-pyrrolidinyl)phenyl]ethoxy]-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-4,7-dimethyl-5-[2-oxo-2-(4-pyrrolidin-1-ylphenyl)ethoxy]chromen-2-one Traditional Name: 3-benzyl-5-[2-keto-2-(4-pyrrolidinophenyl)ethoxy]-4,7-dimethyl-coumarin Formula: C30H29NO4 MolecularWeight: 467.55556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OCC(=O)C4=CC=C(C=C4)N5CCCC5

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OCC(=O)C4=CC=C(C=C4)N5CCCC5

InChI

InChI=1S/C30H29NO4/c1-20-16-27(34-19-26(32)23-10-12-24(13-11-23)31-14-6-7-15-31)29-21(2)25(30(33)35-28(29)17-20)18-22-8-4-3-5-9-22/h3-5,8-13,16-17H,6-7,14-15,18-19H2,1-2H3