2-azanyl-3-(4-butoxycarbonyl-1H-indol-3-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(4-butoxycarbonyl-1H-indol-3-yl)propanoic acid Openeye Name: 2-amino-3-(4-butoxycarbonyl-1H-indol-3-yl)propanoic acid CAS Name: 2-amino-3-[4-[butoxy(oxo)methyl]-1H-indol-3-yl]propanoic acid IUPAC Name: 2-amino-3-(4-butoxycarbonyl-1H-indol-3-yl)propanoic acid Traditional Name: 2-amino-3-(4-butoxycarbonyl-1H-indol-3-yl)propionic acid Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C2C(=CC=C1)NC=C2CC(C(=O)O)N

Isomeric SMILES

CCCCOC(=O)C1=C2C(=CC=C1)NC=C2CC(C(=O)O)N

InChI

InChI=1S/C16H20N2O4/c1-2-3-7-22-16(21)11-5-4-6-13-14(11)10(9-18-13)8-12(17)15(19)20/h4-6,9,12,18H,2-3,7-8,17H2,1H3,(H,19,20)