2-[2-[(3-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 2-[2-[(3-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 2-[2-[(3-methoxyphenyl)methylamino]-2-oxo-ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid CAS Name: 2-[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl]-1,4-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 2-[2-[(3-methoxyphenyl)methylamino]-2-oxoethyl]-1,4-dimethylpyrrole-3-carboxylic acid Traditional Name: 2-[2-keto-2-(m-anisylamino)ethyl]-1,4-dimethyl-pyrrole-3-carboxylic acid Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C1C(=O)O)CC(=O)NCC2=CC(=CC=C2)OC)C

Isomeric SMILES

CC1=CN(C(=C1C(=O)O)CC(=O)NCC2=CC(=CC=C2)OC)C

InChI

InChI=1S/C17H20N2O4/c1-11-10-19(2)14(16(11)17(21)22)8-15(20)18-9-12-5-4-6-13(7-12)23-3/h4-7,10H,8-9H2,1-3H3,(H,18,20)(H,21,22)