2-[6-[(4-carbamimidoylphenyl)carbamoyl]-2-ethyl-3,4-dihydro-2H-chromen-3-yl]ethanoate

Systemtic Name: 2-[6-[(4-carbamimidoylphenyl)carbamoyl]-2-ethyl-3,4-dihydro-2H-chromen-3-yl]ethanoate Openeye Name: 2-[6-[(4-carbamimidoylphenyl)carbamoyl]-2-ethyl-chroman-3-yl]acetate CAS Name: 2-[6-[(4-carbamimidoylanilino)-oxomethyl]-2-ethyl-3,4-dihydro-2H-1-benzopyran-3-yl]acetate IUPAC Name: 2-[6-[(4-carbamimidoylphenyl)carbamoyl]-2-ethyl-3,4-dihydro-2H-chromen-3-yl]acetate Traditional Name: 2-[6-[(4-amidinophenyl)carbamoyl]-2-ethyl-chroman-3-yl]acetate Formula: C21H22N3O4- MolecularWeight: 380.41708

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(CC2=C(O1)C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=N)N)CC(=O)[O-]

Isomeric SMILES

CCC1C(CC2=C(O1)C=CC(=C2)C(=O)NC3=CC=C(C=C3)C(=N)N)CC(=O)[O-]

InChI

InChI=1S/C21H23N3O4/c1-2-17-15(11-19(25)26)10-14-9-13(5-8-18(14)28-17)21(27)24-16-6-3-12(4-7-16)20(22)23/h3-9,15,17H,2,10-11H2,1H3,(H3,22,23)(H,24,27)(H,25,26)/p-1