2-methylbutyl 2-(4-aminophenyl)-3-(4-decoxyphenyl)cyclopropene-1-carboxylate

Systemtic Name: 2-methylbutyl 2-(4-aminophenyl)-3-(4-decoxyphenyl)cyclopropene-1-carboxylate Openeye Name: 2-methylbutyl 2-(4-aminophenyl)-3-(4-decoxyphenyl)cyclopropene-1-carboxylate CAS Name: 2-(4-aminophenyl)-3-(4-decoxyphenyl)-1-cyclopropenecarboxylic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 2-(4-aminophenyl)-3-(4-decoxyphenyl)cyclopropene-1-carboxylate Traditional Name: 2-(4-aminophenyl)-3-(4-decoxyphenyl)cyclopropene-1-carboxylic acid 2-methylbutyl ester Formula: C31H43NO3 MolecularWeight: 477.67802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2C(=C2C(=O)OCC(C)CC)C3=CC=C(C=C3)N

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2C(=C2C(=O)OCC(C)CC)C3=CC=C(C=C3)N

InChI

InChI=1S/C31H43NO3/c1-4-6-7-8-9-10-11-12-21-34-27-19-15-25(16-20-27)29-28(24-13-17-26(32)18-14-24)30(29)31(33)35-22-23(3)5-2/h13-20,23,29H,4-12,21-22,32H2,1-3H3