ethyl 2-[2-[(6-carbamimidoyl-1-ethyl-indazol-3-yl)methyl]phenyl]-5-methoxy-benzoate

Systemtic Name: ethyl 2-[2-[(6-carbamimidoyl-1-ethyl-indazol-3-yl)methyl]phenyl]-5-methoxy-benzoate Openeye Name: ethyl 2-[2-[(6-carbamimidoyl-1-ethyl-indazol-3-yl)methyl]phenyl]-5-methoxy-benzoate CAS Name: 2-[2-[(6-carbamimidoyl-1-ethyl-3-indazolyl)methyl]phenyl]-5-methoxybenzoic acid ethyl ester IUPAC Name: ethyl 2-[2-[(6-carbamimidoyl-1-ethylindazol-3-yl)methyl]phenyl]-5-methoxybenzoate Traditional Name: 2-[2-[(6-amidino-1-ethyl-indazol-3-yl)methyl]phenyl]-5-methoxy-benzoic acid ethyl ester Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C(=N)N)C(=N1)CC3=CC=CC=C3C4=C(C=C(C=C4)OC)C(=O)OCC

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C(=N)N)C(=N1)CC3=CC=CC=C3C4=C(C=C(C=C4)OC)C(=O)OCC

InChI

InChI=1S/C27H28N4O3/c1-4-31-25-15-18(26(28)29)10-12-22(25)24(30-31)14-17-8-6-7-9-20(17)21-13-11-19(33-3)16-23(21)27(32)34-5-2/h6-13,15-16H,4-5,14H2,1-3H3,(H3,28,29)