ethyl 2-[[2-(7-carbamimidoylnaphthalen-2-yl)-5-piperidin-4-yloxy-2,3-dihydroindol-1-yl]sulfonyl]ethanoate

Systemtic Name: ethyl 2-[[2-(7-carbamimidoylnaphthalen-2-yl)-5-piperidin-4-yloxy-2,3-dihydroindol-1-yl]sulfonyl]ethanoate Openeye Name: ethyl 2-[2-(7-carbamimidoyl-2-naphthyl)-5-(4-piperidyloxy)indolin-1-yl]sulfonylacetate CAS Name: 2-[[2-(7-carbamimidoyl-2-naphthalenyl)-5-(4-piperidinyloxy)-2,3-dihydroindol-1-yl]sulfonyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-(7-carbamimidoylnaphthalen-2-yl)-5-piperidin-4-yloxy-2,3-dihydroindol-1-yl]sulfonyl]acetate Traditional Name: 2-[2-(7-amidino-2-naphthyl)-5-(4-piperidyloxy)indolin-1-yl]sulfonylacetic acid ethyl ester Formula: C28H32N4O5S MolecularWeight: 536.64248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)N1C(CC2=C1C=CC(=C2)OC3CCNCC3)C4=CC5=C(C=C4)C=CC(=C5)C(=N)N

Isomeric SMILES

CCOC(=O)CS(=O)(=O)N1C(CC2=C1C=CC(=C2)OC3CCNCC3)C4=CC5=C(C=C4)C=CC(=C5)C(=N)N

InChI

InChI=1S/C28H32N4O5S/c1-2-36-27(33)17-38(34,35)32-25-8-7-24(37-23-9-11-31-12-10-23)15-22(25)16-26(32)19-5-3-18-4-6-20(28(29)30)14-21(18)13-19/h3-8,13-15,23,26,31H,2,9-12,16-17H2,1H3,(H3,29,30)