[(E)-[4-(2-phenylethanoylamino)-3-pyrrolidin-1-yl-cyclohexylidene]amino] ethanoate

Systemtic Name: [(E)-[4-(2-phenylethanoylamino)-3-pyrrolidin-1-yl-cyclohexylidene]amino] ethanoate Openeye Name: [(E)-[4-[(2-phenylacetyl)amino]-3-pyrrolidin-1-yl-cyclohexylidene]amino] acetate CAS Name: acetic acid [(E)-[4-[(1-oxo-2-phenylethyl)amino]-3-(1-pyrrolidinyl)cyclohexylidene]amino] ester IUPAC Name: [(E)-[4-[(2-phenylacetyl)amino]-3-pyrrolidin-1-ylcyclohexylidene]amino] acetate Traditional Name: acetic acid [(E)-[4-[(2-phenylacetyl)amino]-3-pyrrolidino-cyclohexylidene]amino] ester Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON=C1CCC(C(C1)N2CCCC2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)O/N=C/1\CCC(C(C1)N2CCCC2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H27N3O3/c1-15(24)26-22-17-9-10-18(19(14-17)23-11-5-6-12-23)21-20(25)13-16-7-3-2-4-8-16/h2-4,7-8,18-19H,5-6,9-14H2,1H3,(H,21,25)/b22-17+