methyl 2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]-4-(propylamino)benzoate

Systemtic Name: methyl 2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]-4-(propylamino)benzoate Openeye Name: methyl 2-[[(E)-3-(2-naphthyl)but-2-enoyl]amino]-4-(propylamino)benzoate CAS Name: 2-[[(E)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]-4-(propylamino)benzoic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]-4-(propylamino)benzoate Traditional Name: 2-[[(E)-3-(2-naphthyl)but-2-enoyl]amino]-4-(propylamino)benzoic acid methyl ester Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=CC(=C(C=C1)C(=O)OC)NC(=O)C=C(C)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCCNC1=CC(=C(C=C1)C(=O)OC)NC(=O)/C=C(\C)/C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C25H26N2O3/c1-4-13-26-21-11-12-22(25(29)30-3)23(16-21)27-24(28)14-17(2)19-10-9-18-7-5-6-8-20(18)15-19/h5-12,14-16,26H,4,13H2,1-3H3,(H,27,28)/b17-14+