methyl (E)-3-[3-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl-pyridin-4-ylcarbonyl-amino]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl-pyridin-4-ylcarbonyl-amino]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[3-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl-(pyridine-4-carbonyl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[3-[(8-methoxy-2,2-dimethyl-1-benzopyran-7-yl)methyl-[oxo(pyridin-4-yl)methyl]amino]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-[(8-methoxy-2,2-dimethylchromen-7-yl)methyl-(pyridine-4-carbonyl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[3-[isonicotinoyl-[(8-methoxy-2,2-dimethyl-chromen-7-yl)methyl]amino]phenyl]acrylic acid methyl ester Formula: C29H28N2O5 MolecularWeight: 484.54302

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=C(O1)C(=C(C=C2)CN(C3=CC=CC(=C3)C=CC(=O)OC)C(=O)C4=CC=NC=C4)OC)C

Isomeric SMILES

CC1(C=CC2=C(O1)C(=C(C=C2)CN(C3=CC=CC(=C3)/C=C/C(=O)OC)C(=O)C4=CC=NC=C4)OC)C

InChI

InChI=1S/C29H28N2O5/c1-29(2)15-12-21-9-10-23(26(35-4)27(21)36-29)19-31(28(33)22-13-16-30-17-14-22)24-7-5-6-20(18-24)8-11-25(32)34-3/h5-18H,19H2,1-4H3/b11-8+