methyl (E)-3-[2-(5-acetyloxy-3,6-dimethoxy-9H-phenanthren-4a-yl)ethyl-methyl-amino]prop-2-enoate

Systemtic Name: methyl (E)-3-[2-(5-acetyloxy-3,6-dimethoxy-9H-phenanthren-4a-yl)ethyl-methyl-amino]prop-2-enoate Openeye Name: methyl (E)-3-[2-(5-acetoxy-3,6-dimethoxy-9H-phenanthren-4a-yl)ethyl-methyl-amino]prop-2-enoate CAS Name: (E)-3-[2-(5-acetyloxy-3,6-dimethoxy-9H-phenanthren-4a-yl)ethyl-methylamino]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[2-(5-acetyloxy-3,6-dimethoxy-9H-phenanthren-4a-yl)ethyl-methylamino]prop-2-enoate Traditional Name: (E)-3-[2-(5-acetoxy-3,6-dimethoxy-9H-phenanthren-4a-yl)ethyl-methyl-amino]acrylic acid methyl ester Formula: C25H29NO6 MolecularWeight: 439.50086

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC2=C1C3(C=C(C=CC3=CC2)OC)CCN(C)C=CC(=O)OC)OC

Isomeric SMILES

CC(=O)OC1=C(C=CC2=C1C3(C=C(C=CC3=CC2)OC)CCN(C)/C=C/C(=O)OC)OC

InChI

InChI=1S/C25H29NO6/c1-17(27)32-24-21(30-4)11-7-18-6-8-19-9-10-20(29-3)16-25(19,23(18)24)13-15-26(2)14-12-22(28)31-5/h7-12,14,16H,6,13,15H2,1-5H3/b14-12+