3-[[4-[[azanyl(heptan-3-yl)amino]methyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[[azanyl(heptan-3-yl)amino]methyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[[amino(1-ethylpentyl)amino]methyl]benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[[amino(heptan-3-yl)amino]methyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[[amino(heptan-3-yl)amino]methyl]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[[amino(1-ethylpentyl)amino]methyl]benzoyl]amino]propionic acid Formula: C18H29N3O3 MolecularWeight: 335.44116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)N(CC1=CC=C(C=C1)C(=O)NCCC(=O)O)N

Isomeric SMILES

CCCCC(CC)N(CC1=CC=C(C=C1)C(=O)NCCC(=O)O)N

InChI

InChI=1S/C18H29N3O3/c1-3-5-6-16(4-2)21(19)13-14-7-9-15(10-8-14)18(24)20-12-11-17(22)23/h7-10,16H,3-6,11-13,19H2,1-2H3,(H,20,24)(H,22,23)