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

Systemtic Name: ethyl 3-[2-(7-carbamimidoylnaphthalen-2-yl)-5-piperidin-4-yloxy-2,3-dihydroindol-1-yl]-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[2-(7-carbamimidoyl-2-naphthyl)-5-(4-piperidyloxy)indolin-1-yl]-3-oxo-propanoate CAS Name: 3-[2-(7-carbamimidoyl-2-naphthalenyl)-5-(4-piperidinyloxy)-2,3-dihydroindol-1-yl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(7-carbamimidoylnaphthalen-2-yl)-5-piperidin-4-yloxy-2,3-dihydroindol-1-yl]-3-oxopropanoate Traditional Name: 3-[2-(7-amidino-2-naphthyl)-5-(4-piperidyloxy)indolin-1-yl]-3-keto-propionic acid ethyl ester Formula: C29H32N4O4 MolecularWeight: 500.58878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H32N4O4/c1-2-36-28(35)17-27(34)33-25-8-7-24(37-23-9-11-32-12-10-23)15-22(25)16-26(33)19-5-3-18-4-6-20(29(30)31)14-21(18)13-19/h3-8,13-15,23,26,32H,2,9-12,16-17H2,1H3,(H3,30,31)