(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 4-methylsulfanyl-2-[(3,4,5-trimethoxyphenyl)carbonylamino]butanoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 4-methylsulfanyl-2-[(3,4,5-trimethoxyphenyl)carbonylamino]butanoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 4-methylsulfanyl-2-[(3,4,5-trimethoxybenzoyl)amino]butanoate CAS Name: 4-(methylthio)-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]butanoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 4-methylsulfanyl-2-[(3,4,5-trimethoxybenzoyl)amino]butanoate Traditional Name: 4-(methylthio)-2-[(3,4,5-trimethoxybenzoyl)amino]butyric acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C29H35NO8S MolecularWeight: 557.6551

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C(CCSC)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C(CCSC)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C(C)C

InChI

InChI=1S/C29H35NO8S/c1-16(2)20-14-21-19(13-26(31)38-23(21)10-17(20)3)15-37-29(33)22(8-9-39-7)30-28(32)18-11-24(34-4)27(36-6)25(12-18)35-5/h10-14,16,22H,8-9,15H2,1-7H3,(H,30,32)