N-(3-carbamimidoylphenyl)-3-[[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]amino]propanamide

Systemtic Name: N-(3-carbamimidoylphenyl)-3-[[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]amino]propanamide Openeye Name: N-(3-carbamimidoylphenyl)-3-[4-[(1-ethanimidoyl-4-piperidyl)oxy]anilino]propanamide CAS Name: N-(3-carbamimidoylphenyl)-3-[4-[[1-(1-iminoethyl)-4-piperidinyl]oxy]anilino]propanamide IUPAC Name: N-(3-carbamimidoylphenyl)-3-[4-(1-ethanimidoylpiperidin-4-yl)oxyanilino]propanamide Traditional Name: 3-[4-[(1-acetimidoyl-4-piperidyl)oxy]anilino]-N-(3-amidinophenyl)propionamide Formula: C23H30N6O2 MolecularWeight: 422.5233

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)NCCC(=O)NC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC=C(C=C2)NCCC(=O)NC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C23H30N6O2/c1-16(24)29-13-10-21(11-14-29)31-20-7-5-18(6-8-20)27-12-9-22(30)28-19-4-2-3-17(15-19)23(25)26/h2-8,15,21,24,27H,9-14H2,1H3,(H3,25,26)(H,28,30)