3-[(2R)-2-methylbutoxy]-6-[[(4-pentylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 3-[(2R)-2-methylbutoxy]-6-[[(4-pentylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 3-[(2R)-2-methylbutoxy]-6-[(4-pentylanilino)methylene]cyclohexa-2,4-dien-1-one CAS Name: 3-[(2R)-2-methylbutoxy]-6-[(4-pentylanilino)methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 3-[(2R)-2-methylbutoxy]-6-[(4-pentylanilino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[(4-amylanilino)methylene]-3-[(2R)-2-methylbutoxy]cyclohexa-2,4-dien-1-one Formula: C23H31NO2 MolecularWeight: 353.49774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC=C2C=CC(=CC2=O)OCC(C)CC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC=C2C=CC(=CC2=O)OC[C@H](C)CC

InChI

InChI=1S/C23H31NO2/c1-4-6-7-8-19-9-12-21(13-10-19)24-16-20-11-14-22(15-23(20)25)26-17-18(3)5-2/h9-16,18,24H,4-8,17H2,1-3H3/t18-/m1/s1