ethyl 4-azanyl-2-[butoxycarbonyl-(phenylmethyl)amino]-5-(1H-indol-3-yl)-3-oxidanylidene-pentanoate

Systemtic Name: ethyl 4-azanyl-2-[butoxycarbonyl-(phenylmethyl)amino]-5-(1H-indol-3-yl)-3-oxidanylidene-pentanoate Openeye Name: ethyl 4-amino-2-[benzyl(butoxycarbonyl)amino]-5-(1H-indol-3-yl)-3-oxo-pentanoate CAS Name: 4-amino-2-[[butoxy(oxo)methyl]-(phenylmethyl)amino]-5-(1H-indol-3-yl)-3-oxopentanoic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[benzyl(butoxycarbonyl)amino]-5-(1H-indol-3-yl)-3-oxopentanoate Traditional Name: 4-amino-2-[benzyl(butoxycarbonyl)amino]-5-(1H-indol-3-yl)-3-keto-valeric acid ethyl ester Formula: C27H33N3O5 MolecularWeight: 479.56802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N(CC1=CC=CC=C1)C(C(=O)C(CC2=CNC3=CC=CC=C32)N)C(=O)OCC

Isomeric SMILES

CCCCOC(=O)N(CC1=CC=CC=C1)C(C(=O)C(CC2=CNC3=CC=CC=C32)N)C(=O)OCC

InChI

InChI=1S/C27H33N3O5/c1-3-5-15-35-27(33)30(18-19-11-7-6-8-12-19)24(26(32)34-4-2)25(31)22(28)16-20-17-29-23-14-10-9-13-21(20)23/h6-14,17,22,24,29H,3-5,15-16,18,28H2,1-2H3