ethyl 3-[[2-azanyl-4-[(1-carbamimidoylpiperidin-3-yl)methylamino]-4-oxidanylidene-butanoyl]-cyclopropyl-amino]propanoate

Systemtic Name: ethyl 3-[[2-azanyl-4-[(1-carbamimidoylpiperidin-3-yl)methylamino]-4-oxidanylidene-butanoyl]-cyclopropyl-amino]propanoate Openeye Name: ethyl 3-[[2-amino-4-[(1-carbamimidoyl-3-piperidyl)methylamino]-4-oxo-butanoyl]-cyclopropyl-amino]propanoate CAS Name: 3-[[2-amino-4-[(1-carbamimidoyl-3-piperidinyl)methylamino]-1,4-dioxobutyl]-cyclopropylamino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-amino-4-[(1-carbamimidoylpiperidin-3-yl)methylamino]-4-oxobutanoyl]-cyclopropylamino]propanoate Traditional Name: 3-[[4-[(1-amidino-3-piperidyl)methylamino]-2-amino-4-keto-butanoyl]-cyclopropyl-amino]propionic acid ethyl ester Formula: C19H34N6O4 MolecularWeight: 410.51106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(C1CC1)C(=O)C(CC(=O)NCC2CCCN(C2)C(=N)N)N

Isomeric SMILES

CCOC(=O)CCN(C1CC1)C(=O)C(CC(=O)NCC2CCCN(C2)C(=N)N)N

InChI

InChI=1S/C19H34N6O4/c1-2-29-17(27)7-9-25(14-5-6-14)18(28)15(20)10-16(26)23-11-13-4-3-8-24(12-13)19(21)22/h13-15H,2-12,20H2,1H3,(H3,21,22)(H,23,26)