phenanthridin-6-ylmethyl 3-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: phenanthridin-6-ylmethyl 3-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: phenanthridin-6-ylmethyl 3-(thiophene-2-carbonylamino)propanoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 3-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-(2-thenoylamino)propionic acid phenanthridin-6-ylmethyl ester Formula: C22H18N2O3S MolecularWeight: 390.45492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3N=C2COC(=O)CCNC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N=C2COC(=O)CCNC(=O)C4=CC=CS4

InChI

InChI=1S/C22H18N2O3S/c25-21(11-12-23-22(26)20-10-5-13-28-20)27-14-19-17-8-2-1-6-15(17)16-7-3-4-9-18(16)24-19/h1-10,13H,11-12,14H2,(H,23,26)