methyl 3-[(2-methoxyphenyl)carbonylamino]-5-[(pent-4-enoylamino)methyl]benzoate

Systemtic Name: methyl 3-[(2-methoxyphenyl)carbonylamino]-5-[(pent-4-enoylamino)methyl]benzoate Openeye Name: methyl 3-[(2-methoxybenzoyl)amino]-5-[(pent-4-enoylamino)methyl]benzoate CAS Name: 3-[[(2-methoxyphenyl)-oxomethyl]amino]-5-[(1-oxopent-4-enylamino)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(2-methoxybenzoyl)amino]-5-[(pent-4-enoylamino)methyl]benzoate Traditional Name: 3-(o-anisoylamino)-5-[(pent-4-enoylamino)methyl]benzoic acid methyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC(=CC(=C2)CNC(=O)CCC=C)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC(=CC(=C2)CNC(=O)CCC=C)C(=O)OC

InChI

InChI=1S/C22H24N2O5/c1-4-5-10-20(25)23-14-15-11-16(22(27)29-3)13-17(12-15)24-21(26)18-8-6-7-9-19(18)28-2/h4,6-9,11-13H,1,5,10,14H2,2-3H3,(H,23,25)(H,24,26)