ethyl 4-[[1-[3-[(4-carbamimidoylphenyl)methyl]-1-methyl-2-oxidanylidene-quinoxalin-6-yl]cyclopropyl]-cyclopentyl-amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[1-[3-[(4-carbamimidoylphenyl)methyl]-1-methyl-2-oxidanylidene-quinoxalin-6-yl]cyclopropyl]-cyclopentyl-amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[1-[3-[(4-carbamimidoylphenyl)methyl]-1-methyl-2-oxo-quinoxalin-6-yl]cyclopropyl]-cyclopentyl-amino]-4-oxo-butanoate CAS Name: 4-[[1-[3-[(4-carbamimidoylphenyl)methyl]-1-methyl-2-oxo-6-quinoxalinyl]cyclopropyl]-cyclopentylamino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[1-[3-[(4-carbamimidoylphenyl)methyl]-1-methyl-2-oxoquinoxalin-6-yl]cyclopropyl]-cyclopentylamino]-4-oxobutanoate Traditional Name: 4-[[1-[3-(4-amidinobenzyl)-2-keto-1-methyl-quinoxalin-6-yl]cyclopropyl]-cyclopentyl-amino]-4-keto-butyric acid ethyl ester Formula: C31H37N5O4 MolecularWeight: 543.65658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(C1CCCC1)C2(CC2)C3=CC4=C(C=C3)N(C(=O)C(=N4)CC5=CC=C(C=C5)C(=N)N)C

Isomeric SMILES

CCOC(=O)CCC(=O)N(C1CCCC1)C2(CC2)C3=CC4=C(C=C3)N(C(=O)C(=N4)CC5=CC=C(C=C5)C(=N)N)C

InChI

InChI=1S/C31H37N5O4/c1-3-40-28(38)15-14-27(37)36(23-6-4-5-7-23)31(16-17-31)22-12-13-26-24(19-22)34-25(30(39)35(26)2)18-20-8-10-21(11-9-20)29(32)33/h8-13,19,23H,3-7,14-18H2,1-2H3,(H3,32,33)