(7-azanyl-3-phenethyl-1H-indol-2-yl)carbamoylphosphonic acid

Systemtic Name: (7-azanyl-3-phenethyl-1H-indol-2-yl)carbamoylphosphonic acid Openeye Name: (7-amino-3-phenethyl-1H-indol-2-yl)carbamoylphosphonic acid CAS Name: [[(7-amino-3-phenethyl-1H-indol-2-yl)amino]-oxomethyl]phosphonic acid IUPAC Name: (7-amino-3-phenethyl-1H-indol-2-yl)carbamoylphosphonic acid Traditional Name: (7-amino-3-phenethyl-1H-indol-2-yl)carbamoylphosphonic acid Formula: C17H18N3O4P MolecularWeight: 359.316281

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C(NC3=C2C=CC=C3N)NC(=O)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C(NC3=C2C=CC=C3N)NC(=O)P(=O)(O)O

InChI

InChI=1S/C17H18N3O4P/c18-14-8-4-7-12-13(10-9-11-5-2-1-3-6-11)16(19-15(12)14)20-17(21)25(22,23)24/h1-8,19H,9-10,18H2,(H,20,21)(H2,22,23,24)