methyl 4-methyl-2-[1-(1-methylindol-3-yl)ethyl]-2-nitro-pent-4-enoate

Systemtic Name: methyl 4-methyl-2-[1-(1-methylindol-3-yl)ethyl]-2-nitro-pent-4-enoate Openeye Name: methyl 4-methyl-2-[1-(1-methylindol-3-yl)ethyl]-2-nitro-pent-4-enoate CAS Name: 4-methyl-2-[1-(1-methyl-3-indolyl)ethyl]-2-nitro-4-pentenoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[1-(1-methylindol-3-yl)ethyl]-2-nitropent-4-enoate Traditional Name: 4-methyl-2-[1-(1-methylindol-3-yl)ethyl]-2-nitro-pent-4-enoic acid methyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN(C2=CC=CC=C21)C)C(CC(=C)C)(C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CN(C2=CC=CC=C21)C)C(CC(=C)C)(C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O4/c1-12(2)10-18(20(22)23,17(21)24-5)13(3)15-11-19(4)16-9-7-6-8-14(15)16/h6-9,11,13H,1,10H2,2-5H3