2-[2-[(4-carbamimidoylphenyl)carbonylamino]-3,4-dihydro-2H-chromen-3-yl]ethanoate hydrochloride

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbonylamino]-3,4-dihydro-2H-chromen-3-yl]ethanoate hydrochloride Openeye Name: 2-[2-[(4-carbamimidoylbenzoyl)amino]chroman-3-yl]acetate hydrochloride CAS Name: 2-[2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-3,4-dihydro-2H-1-benzopyran-3-yl]acetate hydrochloride IUPAC Name: 2-[2-[(4-carbamimidoylbenzoyl)amino]-3,4-dihydro-2H-chromen-3-yl]acetate hydrochloride Traditional Name: 2-[2-[(4-amidinobenzoyl)amino]chroman-3-yl]acetate hydrochloride Formula: C19H19ClN3O4- MolecularWeight: 388.82486

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)C(=N)N)CC(=O)[O-].Cl

Isomeric SMILES

C1C(C(OC2=CC=CC=C21)NC(=O)C3=CC=C(C=C3)C(=N)N)CC(=O)[O-].Cl

InChI

InChI=1S/C19H19N3O4.ClH/c20-17(21)11-5-7-12(8-6-11)18(25)22-19-14(10-16(23)24)9-13-3-1-2-4-15(13)26-19;/h1-8,14,19H,9-10H2,(H3,20,21)(H,22,25)(H,23,24);1H/p-1