[[3-methyl-3-(4-phenylbut-3-ynyl)cyclobutylidene]amino] benzoate

Systemtic Name: [[3-methyl-3-(4-phenylbut-3-ynyl)cyclobutylidene]amino] benzoate Openeye Name: [[3-methyl-3-(4-phenylbut-3-ynyl)cyclobutylidene]amino] benzoate CAS Name: benzoic acid [[3-methyl-3-(4-phenylbut-3-ynyl)cyclobutylidene]amino] ester IUPAC Name: [[3-methyl-3-(4-phenylbut-3-ynyl)cyclobutylidene]amino] benzoate Traditional Name: benzoic acid [[3-methyl-3-(4-phenylbut-3-ynyl)cyclobutylidene]amino] ester Formula: C22H21NO2 MolecularWeight: 331.40764

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NOC(=O)C2=CC=CC=C2)C1)CCC#CC3=CC=CC=C3

Isomeric SMILES

CC1(CC(=NOC(=O)C2=CC=CC=C2)C1)CCC#CC3=CC=CC=C3

InChI

InChI=1S/C22H21NO2/c1-22(15-9-8-12-18-10-4-2-5-11-18)16-20(17-22)23-25-21(24)19-13-6-3-7-14-19/h2-7,10-11,13-14H,9,15-17H2,1H3