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1-[(3-carbamimidoylphenyl)methyl]indole-3-carboxylic acid

1-[(3-carbamimidoylphenyl)methyl]indole-3-carboxylic acid

Systemtic Name:1-[(3-carbamimidoylphenyl)methyl]indole-3-carboxylic acid
Openeye Name:1-[(3-carbamimidoylphenyl)methyl]indole-3-carboxylic acid
CAS Name:1-[(3-carbamimidoylphenyl)methyl]-3-indolecarboxylic acid
IUPAC Name:1-[(3-carbamimidoylphenyl)methyl]indole-3-carboxylic acid
Traditional Name:1-(3-amidinobenzyl)indole-3-carboxylic acid
Formula: C17H15N3O2
MolecularWeight: 293.3199
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC=CC(=C3)C(=N)N)C(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC=CC(=C3)C(=N)N)C(=O)O


InChI

InChI=1S/C17H15N3O2/c18-16(19)12-5-3-4-11(8-12)9-20-10-14(17(21)22)13-6-1-2-7-15(13)20/h1-8,10H,9H2,(H3,18,19)(H,21,22)


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