ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(3-methoxynaphthalen-2-yl)carbonylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(3-methoxynaphthalen-2-yl)carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(3-methoxynaphthalene-2-carbonyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-2-[[(3-methoxy-2-naphthalenyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[(3-methoxynaphthalene-2-carbonyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 2-[(3-methoxy-2-naphthoyl)amino]-4-methyl-5-piperonyl-thiophene-3-carboxylic acid ethyl ester Formula: C28H25NO6S MolecularWeight: 503.5662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC5=CC=CC=C5C=C4OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC5=CC=CC=C5C=C4OC

InChI

InChI=1S/C28H25NO6S/c1-4-33-28(31)25-16(2)24(12-17-9-10-21-23(11-17)35-15-34-21)36-27(25)29-26(30)20-13-18-7-5-6-8-19(18)14-22(20)32-3/h5-11,13-14H,4,12,15H2,1-3H3,(H,29,30)