N-(2-methoxyphenyl)-1-[(E)-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(2-methoxyphenyl)-1-[(E)-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(2-methoxyphenyl)-1-[(E)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(2-methoxyphenyl)-1-[(E)-1-oxo-3-[4-(2-oxo-1-pyrrolidinyl)phenyl]prop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(2-methoxyphenyl)-1-[(E)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enoyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-3-[4-(2-ketopyrrolidino)phenyl]acryloyl]-N-(2-methoxyphenyl)isonipecotamide Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)C=CC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C26H29N3O4/c1-33-23-6-3-2-5-22(23)27-26(32)20-14-17-28(18-15-20)24(30)13-10-19-8-11-21(12-9-19)29-16-4-7-25(29)31/h2-3,5-6,8-13,20H,4,7,14-18H2,1H3,(H,27,32)/b13-10+