ethyl 7-[(5-carbamimidoyl-1H-indol-2-yl)carbonylamino]-2-ethyl-heptanoate

Systemtic Name: ethyl 7-[(5-carbamimidoyl-1H-indol-2-yl)carbonylamino]-2-ethyl-heptanoate Openeye Name: ethyl 7-[(5-carbamimidoyl-1H-indole-2-carbonyl)amino]-2-ethyl-heptanoate CAS Name: 7-[[(5-carbamimidoyl-1H-indol-2-yl)-oxomethyl]amino]-2-ethylheptanoic acid ethyl ester IUPAC Name: ethyl 7-[(5-carbamimidoyl-1H-indole-2-carbonyl)amino]-2-ethylheptanoate Traditional Name: 7-[(5-amidino-1H-indole-2-carbonyl)amino]-2-ethyl-enanthic acid ethyl ester Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCCCNC(=O)C1=CC2=C(N1)C=CC(=C2)C(=N)N)C(=O)OCC

Isomeric SMILES

CCC(CCCCCNC(=O)C1=CC2=C(N1)C=CC(=C2)C(=N)N)C(=O)OCC

InChI

InChI=1S/C21H30N4O3/c1-3-14(21(27)28-4-2)8-6-5-7-11-24-20(26)18-13-16-12-15(19(22)23)9-10-17(16)25-18/h9-10,12-14,25H,3-8,11H2,1-2H3,(H3,22,23)(H,24,26)