[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]-oxidanylidene-(3-phenoxypropyl)azanium

Systemtic Name: [4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]-oxidanylidene-(3-phenoxypropyl)azanium Openeye Name: [2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]-oxo-(3-phenoxypropyl)ammonium CAS Name: [4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]-oxo-(3-phenoxypropyl)ammonium IUPAC Name: [4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]-oxo-(3-phenoxypropyl)azanium Traditional Name: [2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]-keto-(3-phenoxypropyl)ammonium Formula: C23H29N2O5+ MolecularWeight: 413.48676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[N+](=O)CCCOC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)[N+](=O)CCCOC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H28N2O5/c1-18(2)16-21(24-23(27)30-17-19-10-5-3-6-11-19)22(26)25(28)14-9-15-29-20-12-7-4-8-13-20/h3-8,10-13,18,21H,9,14-17H2,1-2H3/p+1