3-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-8-(methoxymethoxy)naphthalene-2-carboxylic acid

Systemtic Name: 3-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-8-(methoxymethoxy)naphthalene-2-carboxylic acid Openeye Name: 3-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-8-(methoxymethoxy)naphthalene-2-carboxylic acid CAS Name: 3-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-8-(methoxymethoxy)-2-naphthalenecarboxylic acid IUPAC Name: 3-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-8-(methoxymethoxy)naphthalene-2-carboxylic acid Traditional Name: 3-[2-[(4-amidinophenyl)carbamoyl]phenyl]-8-(methoxymethoxy)-2-naphthoic acid Formula: C27H23N3O5 MolecularWeight: 469.48862

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=CC=CC2=CC(=C(C=C21)C(=O)O)C3=CC=CC=C3C(=O)NC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

COCOC1=CC=CC2=CC(=C(C=C21)C(=O)O)C3=CC=CC=C3C(=O)NC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C27H23N3O5/c1-34-15-35-24-8-4-5-17-13-22(23(27(32)33)14-21(17)24)19-6-2-3-7-20(19)26(31)30-18-11-9-16(10-12-18)25(28)29/h2-14H,15H2,1H3,(H3,28,29)(H,30,31)(H,32,33)