2-[2-[(5-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]-5-morpholin-4-ylcarbonyl-phenyl]-5-methoxy-benzoic acid

Systemtic Name: 2-[2-[(5-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]-5-morpholin-4-ylcarbonyl-phenyl]-5-methoxy-benzoic acid Openeye Name: 2-[2-[(5-carbamimidoylindolin-1-yl)methyl]-5-(morpholine-4-carbonyl)phenyl]-5-methoxy-benzoic acid CAS Name: 2-[2-[(5-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]-5-[4-morpholinyl(oxo)methyl]phenyl]-5-methoxybenzoic acid IUPAC Name: 2-[2-[(5-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]-5-(morpholine-4-carbonyl)phenyl]-5-methoxybenzoic acid Traditional Name: 2-[2-[(5-amidinoindolin-1-yl)methyl]-5-(morpholine-4-carbonyl)phenyl]-5-methoxy-benzoic acid Formula: C29H30N4O5 MolecularWeight: 514.5723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=C(C=CC(=C2)C(=O)N3CCOCC3)CN4CCC5=C4C=CC(=C5)C(=N)N)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)C2=C(C=CC(=C2)C(=O)N3CCOCC3)CN4CCC5=C4C=CC(=C5)C(=N)N)C(=O)O

InChI

InChI=1S/C29H30N4O5/c1-37-22-5-6-23(25(16-22)29(35)36)24-15-20(28(34)32-10-12-38-13-11-32)2-3-21(24)17-33-9-8-18-14-19(27(30)31)4-7-26(18)33/h2-7,14-16H,8-13,17H2,1H3,(H3,30,31)(H,35,36)